UCSF

ZINC32152055

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 25 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.20 5.36 -16.52 2 6 0 85 380.285 12
Hi High (pH 8-9.5) 2.39 2.77 -36.44 1 6 -1 91 379.277 12

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )